Alendronate

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 387
Total Number of Articles : 495
PubChem 2088
Molecular Formula

C4H13NO7P2

SMILES

C(CC(O)(P(=O)(O)O)P(=O)(O)O)CN

InChI

InChI=1S/C4H13NO7P2/c5-3-1-2-4(6,13(7,8)9)14(10,11)12/h6H,1-3,5H2,(H2,7,8,9)(H2,10,11,12)

synonyms
  • ALENDRONIC ACID
  • alendronate
  • 66376-36-1
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Properties
Property Value
MW 249.10 g/mol
HBD 6
HBA 8
Rotatable Bond Count 5
Exact Mass 249.01672575 g/mol
Monoisotopic Mass 249.01672575 g/mol
Heavy Atom Count 14
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 257
xlogp -6.5
Topological Polar Surface Area 161